3-bromo-4-chloro-6-methoxy-7-phenylmethoxyquinoline;N-[4-(3-bromo-7-hydroxy-6-methoxyquinolin-4-yl)oxyphenyl]benzamide;3-bromo-6-methoxy-7-phenylmethoxy-1H-quinolin-4-one;N-[4-(3-bromo-6-methoxy-7-phenylmethoxyquinolin-4-yl)oxyphenyl]benzamide;cyclopentyl (2S)-2-amino-4-[4-(4-benzamidophenoxy)-3-bromo-6-methoxyquinolin-7-yl]oxybutanoate;cyclopentyl (2S)-4-[4-(4-benzamidophenoxy)-3-bromo-6-methoxyquinolin-7-yl]oxy-2-[(2-methylpropan-2-yl)oxycarbonylamino]butanoate;cyclopentyl (2S)-4-bromo-2-[(2-methylpropan-2-yl)oxycarbonylamino]butanoate;methane;6-methoxy-7-phenylmethoxy-1H-quinolin-4-one

C189H186Br7ClN14O34 — CID 158338824

IUPAC3-bromo-4-chloro-6-methoxy-7-phenylmethoxyquinoline;N-[4-(3-bromo-7-hydroxy-6-methoxyquinolin-4-yl)oxyphenyl]benzamide;3-bromo-6-methoxy-7-phenylmethoxy-1H-quinolin-4-one;N-[4-(3-bromo-6-methoxy-7-phenylmethoxyquinolin-4-yl)oxyphenyl]benzamide;cyclopentyl (2S)-2-amino-4-[4-(4-benzamidophenoxy)-3-bromo-6-methoxyquinolin-7-yl]oxybutanoate;cyclopentyl (2S)-4-[4-(4-benzamidophenoxy)-3-bromo-6-methoxyquinolin-7-yl]oxy-2-[(2-methylpropan-2-yl)oxycarbonylamino]butanoate;cyclopentyl (2S)-4-bromo-2-[(2-methylpropan-2-yl)oxycarbonylamino]butanoate;methane;6-methoxy-7-phenylmethoxy-1H-quinolin-4-one
SMILESC.C.CC(C)(C)OC(=O)N[C@@H](CCBr)C(=O)OC1CCCC1.COc1cc2c(=O)c(Br)c[nH]c2cc1OCc1ccccc1.COc1cc2c(=O)cc[nH]c2cc1OCc1ccccc1.COc1cc2c(Cl)c(Br)cnc2cc1OCc1ccccc1.COc1cc2c(Oc3ccc(NC(=O)c4ccccc4)cc3)c(Br)cnc2cc1O.COc1cc2c(Oc3ccc(NC(=O)c4ccccc4)cc3)c(Br)cnc2cc1OCC[C@H](N)C(=O)OC1CCCC1.COc1cc2c(Oc3ccc(NC(=O)c4ccccc4)cc3)c(Br)cnc2cc1OCC[C@H](NC(=O)OC(C)(C)C)C(=O)OC1CCCC1.COc1cc2c(Oc3ccc(NC(=O)c4ccccc4)cc3)c(Br)cnc2cc1OCc1ccccc1
InChIInChI=1S/C37H40BrN3O8.C32H32BrN3O6.C30H23BrN2O4.C23H17BrN2O4.C17H13BrClNO2.C17H14BrNO3.C17H15NO3.C14H24BrNO4.2CH4/c1-37(2,3)49-36(44)41-29(35(43)48-25-12-8-9-13-25)18-19-46-32-21-30-27(20-31(32)45-4)33(28(38)22-39-30)47-26-16-14-24(15-17-26)40-34(42)23-10-6-5-7-11-23;1-39-28-17-24-27(18-29(28)40-16-15-26(34)32(38)42-22-9-5-6-10-22)35-19-25(33)30(24)41-23-13-11-21(12-14-23)36-31(37)20-7-3-2-4-8-20;1-35-27-16-24-26(17-28(27)36-19-20-8-4-2-5-9-20)32-18-25(31)29(24)37-23-14-12-22(13-15-23)33-30(34)21-10-6-3-7-11-21;1-29-21-11-17-19(12-20(21)27)25-13-18(24)22(17)30-16-9-7-15(8-10-16)26-23(28)14-5-3-2-4-6-14;1-21-15-7-12-14(20-9-13(18)17(12)19)8-16(15)22-10-11-5-3-2-4-6-11;1-21-15-7-12-14(19-9-13(18)17(12)20)8-16(15)22-10-11-5-3-2-4-6-11;1-20-16-9-13-14(18-8-7-15(13)19)10-17(16)21-11-12-5-3-2-4-6-12;1-14(2,3)20-13(18)16-11(8-9-15)12(17)19-10-6-4-5-7-10;;/h5-7,10-11,14-17,20-22,25,29H,8-9,12-13,18-19H2,1-4H3,(H,40,42)(H,41,44);2-4,7-8,11-14,17-19,22,26H,5-6,9-10,15-16,34H2,1H3,(H,36,37);2-18H,19H2,1H3,(H,33,34);2-13,27H,1H3,(H,26,28);2-9H,10H2,1H3;2-9H,10H2,1H3,(H,19,20);2-10H,11H2,1H3,(H,18,19);10-11H,4-9H2,1-3H3,(H,16,18);2*1H4/t29-;26-;;;;;;11-;;/m00.....0../s1
InChIKeyGQXKIXHHFJEGEX-VLAVBEELSA-N
MW3792.41 g/mol
LogP44.87
Rot. Bonds53

About 3-bromo-4-chloro-6-methoxy-7-phenylmethoxyquinoline;N-[4-(3-bromo-7-hydroxy-6-methoxyquinolin-4-yl)oxyphenyl]benzamide;3-bromo-6-methoxy-7-phenylmethoxy-1H-quinolin-4-one;N-[4-(3-bromo-6-methoxy-7-phenylmethoxyquinolin-4-yl)oxyphenyl]benzamide;cyclopentyl (2S)-2-amino-4-[4-(4-benzamidophenoxy)-3-bromo-6-methoxyquinolin-7-yl]oxybutanoate;cyclopentyl (2S)-4-[4-(4-benzamidophenoxy)-3-bromo-6-methoxyquinolin-7-yl]oxy-2-[(2-methylpropan-2-yl)oxycarbonylamino]butanoate;cyclopentyl (2S)-4-bromo-2-[(2-methylpropan-2-yl)oxycarbonylamino]butanoate;methane;6-methoxy-7-phenylmethoxy-1H-quinolin-4-one

3-bromo-4-chloro-6-methoxy-7-phenylmethoxyquinoline;N-[4-(3-bromo-7-hydroxy-6-methoxyquinolin-4-yl)oxyphenyl]benzamide;3-bromo-6-methoxy-7-phenylmethoxy-1H-quinolin-4-one;N-[4-(3-bromo-6-methoxy-7-phenylmethoxyquinolin-4-yl)oxyphenyl]benzamide;cyclopentyl (2S)-2-amino-4-[4-(4-benzamidophenoxy)-3-bromo-6-methoxyquinolin-7-yl]oxybutanoate;cyclopentyl (2S)-4-[4-(4-benzamidophenoxy)-3-bromo-6-methoxyquinolin-7-yl]oxy-2-[(2-methylpropan-2-yl)oxycarbonylamino]butanoate;cyclopentyl (2S)-4-bromo-2-[(2-methylpropan-2-yl)oxycarbonylamino]butanoate;methane;6-methoxy-7-phenylmethoxy-1H-quinolin-4-one (PubChem CID 158338824) has the molecular formula C189H186Br7ClN14O34 and a molecular weight of 3792.41 g/mol. Its IUPAC name is 3-bromo-4-chloro-6-methoxy-7-phenylmethoxyquinoline;N-[4-(3-bromo-7-hydroxy-6-methoxyquinolin-4-yl)oxyphenyl]benzamide;3-bromo-6-methoxy-7-phenylmethoxy-1H-quinolin-4-one;N-[4-(3-bromo-6-methoxy-7-phenylmethoxyquinolin-4-yl)oxyphenyl]benzamide;cyclopentyl (2S)-2-amino-4-[4-(4-benzamidophenoxy)-3-bromo-6-methoxyquinolin-7-yl]oxybutanoate;cyclopentyl (2S)-4-[4-(4-benzamidophenoxy)-3-bromo-6-methoxyquinolin-7-yl]oxy-2-[(2-methylpropan-2-yl)oxycarbonylamino]butanoate;cyclopentyl (2S)-4-bromo-2-[(2-methylpropan-2-yl)oxycarbonylamino]butanoate;methane;6-methoxy-7-phenylmethoxy-1H-quinolin-4-one.

Molecular Properties

Compound Name3-bromo-4-chloro-6-methoxy-7-phenylmethoxyquinoline;N-[4-(3-bromo-7-hydroxy-6-methoxyquinolin-4-yl)oxyphenyl]benzamide;3-bromo-6-methoxy-7-phenylmethoxy-1H-quinolin-4-one;N-[4-(3-bromo-6-methoxy-7-phenylmethoxyquinolin-4-yl)oxyphenyl]benzamide;cyclopentyl (2S)-2-amino-4-[4-(4-benzamidophenoxy)-3-bromo-6-methoxyquinolin-7-yl]oxybutanoate;cyclopentyl (2S)-4-[4-(4-benzamidophenoxy)-3-bromo-6-methoxyquinolin-7-yl]oxy-2-[(2-methylpropan-2-yl)oxycarbonylamino]butanoate;cyclopentyl (2S)-4-bromo-2-[(2-methylpropan-2-yl)oxycarbonylamino]butanoate;methane;6-methoxy-7-phenylmethoxy-1H-quinolin-4-one
PubChem CID158338824
Molecular FormulaC189H186Br7ClN14O34
Molecular Weight3792.41 g/mol
Exact Mass3782.72
IUPAC Name3-bromo-4-chloro-6-methoxy-7-phenylmethoxyquinoline;N-[4-(3-bromo-7-hydroxy-6-methoxyquinolin-4-yl)oxyphenyl]benzamide;3-bromo-6-methoxy-7-phenylmethoxy-1H-quinolin-4-one;N-[4-(3-bromo-6-methoxy-7-phenylmethoxyquinolin-4-yl)oxyphenyl]benzamide;cyclopentyl (2S)-2-amino-4-[4-(4-benzamidophenoxy)-3-bromo-6-methoxyquinolin-7-yl]oxybutanoate;cyclopentyl (2S)-4-[4-(4-benzamidophenoxy)-3-bromo-6-methoxyquinolin-7-yl]oxy-2-[(2-methylpropan-2-yl)oxycarbonylamino]butanoate;cyclopentyl (2S)-4-bromo-2-[(2-methylpropan-2-yl)oxycarbonylamino]butanoate;methane;6-methoxy-7-phenylmethoxy-1H-quinolin-4-one
SMILESC.C.CC(C)(C)OC(=O)N[C@@H](CCBr)C(=O)OC1CCCC1.COc1cc2c(=O)c(Br)c[nH]c2cc1OCc1ccccc1.COc1cc2c(=O)cc[nH]c2cc1OCc1ccccc1.COc1cc2c(Cl)c(Br)cnc2cc1OCc1ccccc1.COc1cc2c(Oc3ccc(NC(=O)c4ccccc4)cc3)c(Br)cnc2cc1O.COc1cc2c(Oc3ccc(NC(=O)c4ccccc4)cc3)c(Br)cnc2cc1OCC[C@H](N)C(=O)OC1CCCC1.COc1cc2c(Oc3ccc(NC(=O)c4ccccc4)cc3)c(Br)cnc2cc1OCC[C@H](NC(=O)OC(C)(C)C)C(=O)OC1CCCC1.COc1cc2c(Oc3ccc(NC(=O)c4ccccc4)cc3)c(Br)cnc2cc1OCc1ccccc1
InChIInChI=1S/C37H40BrN3O8.C32H32BrN3O6.C30H23BrN2O4.C23H17BrN2O4.C17H13BrClNO2.C17H14BrNO3.C17H15NO3.C14H24BrNO4.2CH4/c1-37(2,3)49-36(44)41-29(35(43)48-25-12-8-9-13-25)18-19-46-32-21-30-27(20-31(32)45-4)33(28(38)22-39-30)47-26-16-14-24(15-17-26)40-34(42)23-10-6-5-7-11-23;1-39-28-17-24-27(18-29(28)40-16-15-26(34)32(38)42-22-9-5-6-10-22)35-19-25(33)30(24)41-23-13-11-21(12-14-23)36-31(37)20-7-3-2-4-8-20;1-35-27-16-24-26(17-28(27)36-19-20-8-4-2-5-9-20)32-18-25(31)29(24)37-23-14-12-22(13-15-23)33-30(34)21-10-6-3-7-11-21;1-29-21-11-17-19(12-20(21)27)25-13-18(24)22(17)30-16-9-7-15(8-10-16)26-23(28)14-5-3-2-4-6-14;1-21-15-7-12-14(20-9-13(18)17(12)19)8-16(15)22-10-11-5-3-2-4-6-11;1-21-15-7-12-14(19-9-13(18)17(12)20)8-16(15)22-10-11-5-3-2-4-6-11;1-20-16-9-13-14(18-8-7-15(13)19)10-17(16)21-11-12-5-3-2-4-6-12;1-14(2,3)20-13(18)16-11(8-9-15)12(17)19-10-6-4-5-7-10;;/h5-7,10-11,14-17,20-22,25,29H,8-9,12-13,18-19H2,1-4H3,(H,40,42)(H,41,44);2-4,7-8,11-14,17-19,22,26H,5-6,9-10,15-16,34H2,1H3,(H,36,37);2-18H,19H2,1H3,(H,33,34);2-13,27H,1H3,(H,26,28);2-9H,10H2,1H3;2-9H,10H2,1H3,(H,19,20);2-10H,11H2,1H3,(H,18,19);10-11H,4-9H2,1-3H3,(H,16,18);2*1H4/t29-;26-;;;;;;11-;;/m00.....0../s1
InChIKeyGQXKIXHHFJEGEX-VLAVBEELSA-N
XLogP44.87
TPSA605.29 Ų
H-Bond Donors10
H-Bond Acceptors40
Rotatable Bonds53
Heavy Atoms245
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5003792.41
LogP ≤ 544.87
H-Bond Donors ≤ 510
H-Bond Acceptors ≤ 1040

Computed Properties (RDKit)

Structural Alerts{'alert_name': '>_2_ester_groups', 'substructure': 'N/A'}, {'alert_name': 'alkyl_halide', 'substructure': 'N/A'}

Analyze 3-bromo-4-chloro-6-methoxy-7-phenylmethoxyquinoline;N-[4-(3-bromo-7-hydroxy-6-methoxyquinolin-4-yl)oxyphenyl]benzamide;3-bromo-6-methoxy-7-phenylmethoxy-1H-quinolin-4-one;N-[4-(3-bromo-6-methoxy-7-phenylmethoxyquinolin-4-yl)oxyphenyl]benzamide;cyclopentyl (2S)-2-amino-4-[4-(4-benzamidophenoxy)-3-bromo-6-methoxyquinolin-7-yl]oxybutanoate;cyclopentyl (2S)-4-[4-(4-benzamidophenoxy)-3-bromo-6-methoxyquinolin-7-yl]oxy-2-[(2-methylpropan-2-yl)oxycarbonylamino]butanoate;cyclopentyl (2S)-4-bromo-2-[(2-methylpropan-2-yl)oxycarbonylamino]butanoate;methane;6-methoxy-7-phenylmethoxy-1H-quinolin-4-one with MolForge

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Related Compounds

4-chloro-6-methoxyquinolin-7-ol;cyclopentyl (2S)-2-amino-4-(4-chloro-6-methoxyquinolin-7-yl)oxybutanoate;cyclopentyl (2S)-2-amino-4-[6-methoxy-4-[4-[[4-(trifluoromethyl)benzoyl]amino]phenoxy]quinolin-7-yl]oxybutanoate;cyclopentyl (2R)-2-(benzylamino)-4-(4-chloro-6-methoxyquinolin-7-yl)oxybutanoate;cyclopentyl (2R)-4-bromo-2-[(2-methylpropan-2-yl)oxycarbonylamino]butanoate;cyclopentyl (2R)-4-(4-chloro-6-methoxyquinolin-7-yl)oxy-2-[(2-methylpropan-2-yl)oxycarbonylamino]butanoate;cyclopentyl (2S)-4-[6-methoxy-4-[4-[[4-(trifluoromethyl)benzoyl]amino]phenoxy]quinolin-7-yl]oxy-2-[(2-methylpropan-2-yl)oxycarbonylamino]butanoate;N-(4-hydroxyphenyl)-4-(trifluoromethyl)benzamide;methane
CID 159101948
cyclopentyl 5-bromo-2-[(2-methylpropan-2-yl)oxycarbonylamino]pentanoate;cyclopentyl 5-[4-[2-fluoro-4-[[4-(trifluoromethyl)phenyl]carbamoylamino]phenoxy]-6-methoxyquinolin-7-yl]oxy-2-[(2-methylpropan-2-yl)oxycarbonylamino]pentanoate;1,2-difluoro-4-nitrobenzene;1-[3-fluoro-4-(7-hydroxy-6-methoxyquinolin-4-yl)oxyphenyl]-3-[4-(trifluoromethyl)phenyl]urea;3-fluoro-4-(6-methoxy-7-phenylmethoxyquinolin-4-yl)oxyaniline;1-[3-fluoro-4-(6-methoxy-7-phenylmethoxyquinolin-4-yl)oxyphenyl]-3-[4-(trifluoromethyl)phenyl]urea;4-(2-fluoro-4-nitrophenoxy)-6-methoxy-7-phenylmethoxyquinoline;1-isocyanato-4-methylbenzene;6-methoxy-7-phenylmethoxy-1H-quinolin-4-one
CID 159361962
4-chloro-6-methoxy-7-phenylmethoxyquinoline;cyclopentyl (2S)-2-amino-4-[6-methoxy-4-[4-[[4-(trifluoromethyl)phenyl]carbamoylamino]phenoxy]quinolin-7-yl]oxybutanoate;cyclopentyl (2S)-4-[6-methoxy-4-[4-[[4-(trifluoromethyl)phenyl]carbamoylamino]phenoxy]quinolin-7-yl]oxy-2-[(2-methylpropan-2-yl)oxycarbonylamino]butanoate;1-[4-(7-hydroxy-6-methoxyquinolin-4-yl)oxyphenyl]-3-[4-(trifluoromethyl)phenyl]urea;N-(4-hydroxyphenyl)acetamide;4-(6-methoxy-7-phenylmethoxyquinolin-4-yl)oxyaniline;N-[4-(6-methoxy-7-phenylmethoxyquinolin-4-yl)oxyphenyl]acetamide;1-[4-(6-methoxy-7-phenylmethoxyquinolin-4-yl)oxyphenyl]-3-[4-(trifluoromethyl)phenyl]urea
CID 159829035
2-(bromomethyl)-1-methylpyrrolidine;cyclopentyl (2S)-2-amino-4-[(2S)-2-[[4-(4-benzamidophenoxy)-6-methoxyquinolin-7-yl]oxymethyl]pyrrolidin-1-yl]butanoate;cyclopentyl (2S)-4-[(2S)-2-[[4-(4-benzamidophenoxy)-6-methoxyquinolin-7-yl]oxymethyl]pyrrolidin-1-yl]-2-[(2-methylpropan-2-yl)oxycarbonylamino]butanoate;cyclopentyl (2S)-4-bromo-2-[(2-methylpropan-2-yl)oxycarbonylamino]butanoate;N-[4-(7-hydroxy-6-methoxyquinolin-4-yl)oxyphenyl]benzamide;N-[4-[6-methoxy-7-[[(2S)-1-methylpyrrolidin-2-yl]methoxy]quinolin-4-yl]oxyphenyl]benzamide;N-[4-[6-methoxy-7-[[(2S)-pyrrolidin-2-yl]methoxy]quinolin-4-yl]oxyphenyl]benzamide
CID 157469757
4-[(4-aminophenyl)disulfanyl]aniline;N-[4-[(4-benzamidophenyl)disulfanyl]phenyl]benzamide;benzoyl chloride;4-chloro-6-methoxyquinolin-7-ol;cyclopentyl (2S)-2-amino-4-[4-(4-benzamidophenyl)sulfanyl-6-methoxyquinolin-7-yl]oxybutanoate;cyclopentyl (2S)-4-[4-(4-benzamidophenyl)sulfanyl-6-methoxyquinolin-7-yl]oxy-2-[(2-methylpropan-2-yl)oxycarbonylamino]butanoate;cyclopentyl (2S)-4-bromo-2-[(2-methylpropan-2-yl)oxycarbonylamino]butanoate;cyclopentyl (2S)-4-(4-chloro-6-methoxyquinolin-7-yl)oxy-2-[(2-methylpropan-2-yl)oxycarbonylamino]butanoate;methane;bis(N-(4-sulfanylphenyl)benzamide)
CID 158132742
4-aminophenol;benzoyl chloride;4-chloro-6-methoxy-7-phenylmethoxyquinoline;cyclopentyl (2S)-2-amino-4-[4-(4-benzamidophenoxy)-6-methoxyquinolin-7-yl]oxybutanoate;cyclopentyl (2S)-4-[4-(4-benzamidophenoxy)-6-methoxyquinolin-7-yl]oxy-2-[(2-methylpropan-2-yl)oxycarbonylamino]butanoate;cyclopentyl (2S)-4-hydroxy-2-methylbutanoate;N,N-diethylethanamine;N-[4-(7-hydroxy-6-methoxyquinolin-4-yl)oxyphenyl]benzamide;bis(N-(4-hydroxyphenyl)benzamide);N-[4-(6-methoxy-7-phenylmethoxyquinolin-4-yl)oxyphenyl]benzamide
CID 158538087
4-aminophenol;benzoyl chloride;4-chloro-6-methoxy-7-phenylmethoxyquinoline;cyclopentyl (2S)-2-amino-4-[4-(4-benzamidophenoxy)-6-methoxyquinolin-7-yl]oxybutanoate;cyclopentyl (2S)-4-[4-(4-benzamidophenoxy)-6-methoxyquinolin-7-yl]oxy-2-[(2-methylpropan-2-yl)oxycarbonylamino]butanoate;cyclopentyl 4-hydroxy-2-methylbutanoate;N,N-diethylethanamine;N-[4-(7-hydroxy-6-methoxyquinolin-4-yl)oxyphenyl]benzamide;bis(N-(4-hydroxyphenyl)benzamide);N-[4-(6-methoxy-7-phenylmethoxyquinolin-4-yl)oxyphenyl]benzamide
CID 158538088
N-[4-(7-hydroxy-6-methoxyquinolin-4-yl)oxyphenyl]benzamide;methane;(3-methylcyclopentyl) (2S)-2-amino-4-[4-(4-benzamidophenoxy)-6-methoxyquinolin-7-yl]oxybutanoate;(3-methylcyclopentyl) (2S)-4-[4-(4-benzamidophenoxy)-6-methoxyquinolin-7-yl]oxy-2-[(2-methylpropan-2-yl)oxycarbonylamino]butanoate;(3-methylcyclopentyl) (2S)-4-bromo-2-[(2-methylpropan-2-yl)oxycarbonylamino]butanoate
CID 158670186
4-chloro-6-methoxy-7-phenylmethoxyquinazoline;cyclopentyl (2S)-2-amino-4-[4-[(2-benzamidopyrimidin-5-yl)amino]-6-methoxyquinazolin-7-yl]oxybutanoate;cyclopentyl (2S)-4-[4-[(2-benzamidopyrimidin-5-yl)amino]-6-methoxyquinazolin-7-yl]oxy-2-[(2-methylpropan-2-yl)oxycarbonylamino]butanoate;cyclopentyl (2S)-4-bromo-2-[(2-methylpropan-2-yl)oxycarbonylamino]butanoate;N-[5-[(7-hydroxy-6-methoxyquinazolin-4-yl)amino]pyrimidin-2-yl]benzamide;methane;N-[5-[(6-methoxy-7-phenylmethoxyquinazolin-4-yl)amino]pyrimidin-2-yl]benzamide
CID 159528552
4-aminophenol;benzoyl chloride;tert-butyl (2S)-2-amino-4-[4-(4-benzamidophenoxy)-6-methoxyquinolin-7-yl]oxybutanoate;tert-butyl (2S)-4-[4-(4-benzamidophenoxy)-6-methoxyquinolin-7-yl]oxy-2-methylbutanoate;tert-butyl (2S)-4-bromo-2-methylbutanoate;4-chloro-6-methoxy-7-phenylmethoxyquinoline;N-[4-(7-hydroxy-6-methoxyquinolin-4-yl)oxyphenyl]benzamide;bis(N-(4-hydroxyphenyl)benzamide);N-[4-[(6-methoxy-7-phenylmethoxyquinolin-4-yl)methyl]phenyl]benzamide
CID 159883075
3-bromo-4-chloro-6-methoxy-7-phenylmethoxyquinoline;4-chloro-3-cyclopropyl-6-methoxy-7-phenylmethoxyquinoline;bis(cyclopentyl (2S)-2-amino-4-[4-(4-benzamidoanilino)-3-cyclopropyl-6-methoxyquinolin-7-yl]oxybutanoate);cyclopentyl (2S)-4-[4-(4-benzamidoanilino)-3-cyclopropyl-6-methoxyquinolin-7-yl]oxy-2-[(2-methylpropan-2-yl)oxycarbonylamino]butanoate;cyclopentyl (2S)-4-bromo-2-[(2-methylpropan-2-yl)oxycarbonylamino]butanoate;N-[4-[(3-cyclopropyl-7-hydroxy-6-methoxyquinolin-4-yl)amino]phenyl]benzamide;N-[4-[(3-cyclopropyl-6-methoxy-7-phenylmethoxyquinolin-4-yl)amino]phenyl]benzamide;methane
CID 160244138
4-chloro-6-methoxy-7-phenylmethoxyquinoline;cyclopentyl (2S)-2-amino-4-[6-methoxy-4-[4-(thiophene-2-carbonylamino)phenoxy]quinolin-7-yl]oxybutanoate;cyclopentyl (2S)-4-bromo-2-[(2-methylpropan-2-yl)oxycarbonylamino]butanoate;cyclopentyl (2S)-4-[6-methoxy-4-[4-(thiophene-2-carbonylamino)phenoxy]quinolin-7-yl]oxy-2-[(2-methylpropan-2-yl)oxycarbonylamino]butanoate;N-[4-(7-hydroxy-6-methoxyquinolin-4-yl)oxyphenyl]thiophene-2-carboxamide;methane;N-[4-(6-methoxy-7-phenylmethoxyquinolin-4-yl)oxyphenyl]thiophene-2-carboxamide
CID 160253793

Frequently Asked Questions

What is the IUPAC name of 3-bromo-4-chloro-6-methoxy-7-phenylmethoxyquinoline;N-[4-(3-bromo-7-hydroxy-6-methoxyquinolin-4-yl)oxyphenyl]benzamide;3-bromo-6-methoxy-7-phenylmethoxy-1H-quinolin-4-one;N-[4-(3-bromo-6-methoxy-7-phenylmethoxyquinolin-4-yl)oxyphenyl]benzamide;cyclopentyl (2S)-2-amino-4-[4-(4-benzamidophenoxy)-3-bromo-6-methoxyquinolin-7-yl]oxybutanoate;cyclopentyl (2S)-4-[4-(4-benzamidophenoxy)-3-bromo-6-methoxyquinolin-7-yl]oxy-2-[(2-methylpropan-2-yl)oxycarbonylamino]butanoate;cyclopentyl (2S)-4-bromo-2-[(2-methylpropan-2-yl)oxycarbonylamino]butanoate;methane;6-methoxy-7-phenylmethoxy-1H-quinolin-4-one?
The IUPAC name of 3-bromo-4-chloro-6-methoxy-7-phenylmethoxyquinoline;N-[4-(3-bromo-7-hydroxy-6-methoxyquinolin-4-yl)oxyphenyl]benzamide;3-bromo-6-methoxy-7-phenylmethoxy-1H-quinolin-4-one;N-[4-(3-bromo-6-methoxy-7-phenylmethoxyquinolin-4-yl)oxyphenyl]benzamide;cyclopentyl (2S)-2-amino-4-[4-(4-benzamidophenoxy)-3-bromo-6-methoxyquinolin-7-yl]oxybutanoate;cyclopentyl (2S)-4-[4-(4-benzamidophenoxy)-3-bromo-6-methoxyquinolin-7-yl]oxy-2-[(2-methylpropan-2-yl)oxycarbonylamino]butanoate;cyclopentyl (2S)-4-bromo-2-[(2-methylpropan-2-yl)oxycarbonylamino]butanoate;methane;6-methoxy-7-phenylmethoxy-1H-quinolin-4-one (CID 158338824) is 3-bromo-4-chloro-6-methoxy-7-phenylmethoxyquinoline;N-[4-(3-bromo-7-hydroxy-6-methoxyquinolin-4-yl)oxyphenyl]benzamide;3-bromo-6-methoxy-7-phenylmethoxy-1H-quinolin-4-one;N-[4-(3-bromo-6-methoxy-7-phenylmethoxyquinolin-4-yl)oxyphenyl]benzamide;cyclopentyl (2S)-2-amino-4-[4-(4-benzamidophenoxy)-3-bromo-6-methoxyquinolin-7-yl]oxybutanoate;cyclopentyl (2S)-4-[4-(4-benzamidophenoxy)-3-bromo-6-methoxyquinolin-7-yl]oxy-2-[(2-methylpropan-2-yl)oxycarbonylamino]butanoate;cyclopentyl (2S)-4-bromo-2-[(2-methylpropan-2-yl)oxycarbonylamino]butanoate;methane;6-methoxy-7-phenylmethoxy-1H-quinolin-4-one.
What is the SMILES notation for 3-bromo-4-chloro-6-methoxy-7-phenylmethoxyquinoline;N-[4-(3-bromo-7-hydroxy-6-methoxyquinolin-4-yl)oxyphenyl]benzamide;3-bromo-6-methoxy-7-phenylmethoxy-1H-quinolin-4-one;N-[4-(3-bromo-6-methoxy-7-phenylmethoxyquinolin-4-yl)oxyphenyl]benzamide;cyclopentyl (2S)-2-amino-4-[4-(4-benzamidophenoxy)-3-bromo-6-methoxyquinolin-7-yl]oxybutanoate;cyclopentyl (2S)-4-[4-(4-benzamidophenoxy)-3-bromo-6-methoxyquinolin-7-yl]oxy-2-[(2-methylpropan-2-yl)oxycarbonylamino]butanoate;cyclopentyl (2S)-4-bromo-2-[(2-methylpropan-2-yl)oxycarbonylamino]butanoate;methane;6-methoxy-7-phenylmethoxy-1H-quinolin-4-one?
The canonical SMILES for 3-bromo-4-chloro-6-methoxy-7-phenylmethoxyquinoline;N-[4-(3-bromo-7-hydroxy-6-methoxyquinolin-4-yl)oxyphenyl]benzamide;3-bromo-6-methoxy-7-phenylmethoxy-1H-quinolin-4-one;N-[4-(3-bromo-6-methoxy-7-phenylmethoxyquinolin-4-yl)oxyphenyl]benzamide;cyclopentyl (2S)-2-amino-4-[4-(4-benzamidophenoxy)-3-bromo-6-methoxyquinolin-7-yl]oxybutanoate;cyclopentyl (2S)-4-[4-(4-benzamidophenoxy)-3-bromo-6-methoxyquinolin-7-yl]oxy-2-[(2-methylpropan-2-yl)oxycarbonylamino]butanoate;cyclopentyl (2S)-4-bromo-2-[(2-methylpropan-2-yl)oxycarbonylamino]butanoate;methane;6-methoxy-7-phenylmethoxy-1H-quinolin-4-one is C.C.CC(C)(C)OC(=O)N[C@@H](CCBr)C(=O)OC1CCCC1.COc1cc2c(=O)c(Br)c[nH]c2cc1OCc1ccccc1.COc1cc2c(=O)cc[nH]c2cc1OCc1ccccc1.COc1cc2c(Cl)c(Br)cnc2cc1OCc1ccccc1.COc1cc2c(Oc3ccc(NC(=O)c4ccccc4)cc3)c(Br)cnc2cc1O.COc1cc2c(Oc3ccc(NC(=O)c4ccccc4)cc3)c(Br)cnc2cc1OCC[C@H](N)C(=O)OC1CCCC1.COc1cc2c(Oc3ccc(NC(=O)c4ccccc4)cc3)c(Br)cnc2cc1OCC[C@H](NC(=O)OC(C)(C)C)C(=O)OC1CCCC1.COc1cc2c(Oc3ccc(NC(=O)c4ccccc4)cc3)c(Br)cnc2cc1OCc1ccccc1.
What is the InChIKey of 3-bromo-4-chloro-6-methoxy-7-phenylmethoxyquinoline;N-[4-(3-bromo-7-hydroxy-6-methoxyquinolin-4-yl)oxyphenyl]benzamide;3-bromo-6-methoxy-7-phenylmethoxy-1H-quinolin-4-one;N-[4-(3-bromo-6-methoxy-7-phenylmethoxyquinolin-4-yl)oxyphenyl]benzamide;cyclopentyl (2S)-2-amino-4-[4-(4-benzamidophenoxy)-3-bromo-6-methoxyquinolin-7-yl]oxybutanoate;cyclopentyl (2S)-4-[4-(4-benzamidophenoxy)-3-bromo-6-methoxyquinolin-7-yl]oxy-2-[(2-methylpropan-2-yl)oxycarbonylamino]butanoate;cyclopentyl (2S)-4-bromo-2-[(2-methylpropan-2-yl)oxycarbonylamino]butanoate;methane;6-methoxy-7-phenylmethoxy-1H-quinolin-4-one?
The InChIKey is GQXKIXHHFJEGEX-VLAVBEELSA-N. The full InChI is InChI=1S/C37H40BrN3O8.C32H32BrN3O6.C30H23BrN2O4.C23H17BrN2O4.C17H13BrClNO2.C17H14BrNO3.C17H15NO3.C14H24BrNO4.2CH4/c1-37(2,3)49-36(44)41-29(35(43)48-25-12-8-9-13-25)18-19-46-32-21-30-27(20-31(32)45-4)33(28(38)22-39-30)47-26-16-14-24(15-17-26)40-34(42)23-10-6-5-7-11-23;1-39-28-17-24-27(18-29(28)40-16-15-26(34)32(38)42-22-9-5-6-10-22)35-19-25(33)30(24)41-23-13-11-21(12-14-23)36-31(37)20-7-3-2-4-8-20;1-35-27-16-24-26(17-28(27)36-19-20-8-4-2-5-9-20)32-18-25(31)29(24)37-23-14-12-22(13-15-23)33-30(34)21-10-6-3-7-11-21;1-29-21-11-17-19(12-20(21)27)25-13-18(24)22(17)30-16-9-7-15(8-10-16)26-23(28)14-5-3-2-4-6-14;1-21-15-7-12-14(20-9-13(18)17(12)19)8-16(15)22-10-11-5-3-2-4-6-11;1-21-15-7-12-14(19-9-13(18)17(12)20)8-16(15)22-10-11-5-3-2-4-6-11;1-20-16-9-13-14(18-8-7-15(13)19)10-17(16)21-11-12-5-3-2-4-6-12;1-14(2,3)20-13(18)16-11(8-9-15)12(17)19-10-6-4-5-7-10;;/h5-7,10-11,14-17,20-22,25,29H,8-9,12-13,18-19H2,1-4H3,(H,40,42)(H,41,44);2-4,7-8,11-14,17-19,22,26H,5-6,9-10,15-16,34H2,1H3,(H,36,37);2-18H,19H2,1H3,(H,33,34);2-13,27H,1H3,(H,26,28);2-9H,10H2,1H3;2-9H,10H2,1H3,(H,19,20);2-10H,11H2,1H3,(H,18,19);10-11H,4-9H2,1-3H3,(H,16,18);2*1H4/t29-;26-;;;;;;11-;;/m00.....0../s1.
What are the key properties of 3-bromo-4-chloro-6-methoxy-7-phenylmethoxyquinoline;N-[4-(3-bromo-7-hydroxy-6-methoxyquinolin-4-yl)oxyphenyl]benzamide;3-bromo-6-methoxy-7-phenylmethoxy-1H-quinolin-4-one;N-[4-(3-bromo-6-methoxy-7-phenylmethoxyquinolin-4-yl)oxyphenyl]benzamide;cyclopentyl (2S)-2-amino-4-[4-(4-benzamidophenoxy)-3-bromo-6-methoxyquinolin-7-yl]oxybutanoate;cyclopentyl (2S)-4-[4-(4-benzamidophenoxy)-3-bromo-6-methoxyquinolin-7-yl]oxy-2-[(2-methylpropan-2-yl)oxycarbonylamino]butanoate;cyclopentyl (2S)-4-bromo-2-[(2-methylpropan-2-yl)oxycarbonylamino]butanoate;methane;6-methoxy-7-phenylmethoxy-1H-quinolin-4-one?
3-bromo-4-chloro-6-methoxy-7-phenylmethoxyquinoline;N-[4-(3-bromo-7-hydroxy-6-methoxyquinolin-4-yl)oxyphenyl]benzamide;3-bromo-6-methoxy-7-phenylmethoxy-1H-quinolin-4-one;N-[4-(3-bromo-6-methoxy-7-phenylmethoxyquinolin-4-yl)oxyphenyl]benzamide;cyclopentyl (2S)-2-amino-4-[4-(4-benzamidophenoxy)-3-bromo-6-methoxyquinolin-7-yl]oxybutanoate;cyclopentyl (2S)-4-[4-(4-benzamidophenoxy)-3-bromo-6-methoxyquinolin-7-yl]oxy-2-[(2-methylpropan-2-yl)oxycarbonylamino]butanoate;cyclopentyl (2S)-4-bromo-2-[(2-methylpropan-2-yl)oxycarbonylamino]butanoate;methane;6-methoxy-7-phenylmethoxy-1H-quinolin-4-one has a molecular weight of 3792.41 g/mol, XLogP of 44.87, 53 rotatable bonds, 10 hydrogen bond donors, and 40 hydrogen bond acceptors.
Where does this data come from?
All data for 3-bromo-4-chloro-6-methoxy-7-phenylmethoxyquinoline;N-[4-(3-bromo-7-hydroxy-6-methoxyquinolin-4-yl)oxyphenyl]benzamide;3-bromo-6-methoxy-7-phenylmethoxy-1H-quinolin-4-one;N-[4-(3-bromo-6-methoxy-7-phenylmethoxyquinolin-4-yl)oxyphenyl]benzamide;cyclopentyl (2S)-2-amino-4-[4-(4-benzamidophenoxy)-3-bromo-6-methoxyquinolin-7-yl]oxybutanoate;cyclopentyl (2S)-4-[4-(4-benzamidophenoxy)-3-bromo-6-methoxyquinolin-7-yl]oxy-2-[(2-methylpropan-2-yl)oxycarbonylamino]butanoate;cyclopentyl (2S)-4-bromo-2-[(2-methylpropan-2-yl)oxycarbonylamino]butanoate;methane;6-methoxy-7-phenylmethoxy-1H-quinolin-4-one is sourced from PubChem (CID 158338824), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).